2-[[4-[[3,5-bis(oxidanylidene)-1-phenyl-pyrazolidin-4-ylidene]methyl]-2-ethoxy-phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 2-[[4-[[3,5-bis(oxidanylidene)-1-phenyl-pyrazolidin-4-ylidene]methyl]-2-ethoxy-phenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[4-[(3,5-dioxo-1-phenyl-pyrazolidin-4-ylidene)methyl]-2-ethoxy-phenoxy]methyl]benzonitrile CAS Name: 2-[[4-[(3,5-dioxo-1-phenyl-4-pyrazolidinylidene)methyl]-2-ethoxyphenoxy]methyl]benzonitrile IUPAC Name: 2-[[4-[(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]-2-ethoxyphenoxy]methyl]benzonitrile Traditional Name: 2-[[4-[(3,5-diketo-1-phenyl-pyrazolidin-4-ylidene)methyl]-2-ethoxy-phenoxy]methyl]benzonitrile Formula: C26H21N3O4 MolecularWeight: 439.46264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)OCC4=CC=CC=C4C#N

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)OCC4=CC=CC=C4C#N

InChI

InChI=1S/C26H21N3O4/c1-2-32-24-15-18(12-13-23(24)33-17-20-9-7-6-8-19(20)16-27)14-22-25(30)28-29(26(22)31)21-10-4-3-5-11-21/h3-15H,2,17H2,1H3,(H,28,30)